Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bfe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A NE2 LEU 33.A O no hydrogen 3.116 N/A LYS 7.A N GLN 3.A O no hydrogen 3.325 N/A LEU 8.A N VAL 4.A O no hydrogen 2.992 N/A ALA 9.A N GLN 5.A O no hydrogen 2.940 N/A ALA 10.A N LYS 6.A O no hydrogen 2.976 N/A LEU 11.A N LYS 7.A O no hydrogen 2.746 N/A GLU 12.A N LEU 8.A O no hydrogen 2.997 N/A LYS 13.A N ALA 9.A O no hydrogen 3.214 N/A GLN 14.A N ALA 10.A O no hydrogen 3.186 N/A GLN 14.A NE2 ALA 10.A O no hydrogen 3.297 N/A SER 15.A N LEU 11.A O no hydrogen 3.164 N/A SER 15.A OG GLU 12.A O no hydrogen 2.575 N/A GLY 16.A N GLU 12.A O no hydrogen 3.177 N/A GLY 17.A N SER 15.A OG no hydrogen 3.240 N/A ARG 18.A N THR 238.A O no hydrogen 2.884 N/A ARG 18.A NH1 GLU 38.A OE1 no hydrogen 2.733 N/A ARG 18.A NH1 ARG 39.A O no hydrogen 3.394 N/A ARG 18.A NH2 ARG 39.A O no hydrogen 2.896 N/A LEU 19.A N GLU 12.A OE2 no hydrogen 2.664 N/A GLY 20.A N TYR 236.A O no hydrogen 2.668 N/A VAL 21.A N TYR 34.A O no hydrogen 2.974 N/A ALA 22.A N VAL 234.A O no hydrogen 3.042 N/A LEU 23.A N VAL 32.A O no hydrogen 2.920 N/A ILE 24.A N VAL 232.A O no hydrogen 2.858 N/A ASN 25.A N SER 30.A O no hydrogen 2.975 N/A THR 26.A N PRO 230.A O no hydrogen 3.209 N/A THR 26.A OG1 PRO 230.A O no hydrogen 2.631 N/A ALA 27.A N ASN 25.A OD1 no hydrogen 3.022 N/A ASP 28.A N ASN 25.A O no hydrogen 3.368 N/A ASN 29.A N ASN 25.A O no hydrogen 2.759 N/A SER 30.A N ASP 28.A OD1 no hydrogen 3.313 N/A SER 30.A OG ASP 28.A OD1 no hydrogen 2.862 N/A SER 30.A OG ASP 28.A OD2 no hydrogen 3.478 N/A VAL 32.A N LEU 23.A O no hydrogen 2.950 N/A TYR 34.A N VAL 21.A O no hydrogen 2.926 N/A TYR 34.A OH GLU 12.A OE1 no hydrogen 2.897 N/A ARG 35.A NE GLU 12.A OE2 no hydrogen 2.962 N/A ARG 35.A NH1 GLU 38.A OE2 no hydrogen 2.976 N/A ARG 35.A NH2 GLU 12.A OE1 no hydrogen 3.147 N/A GLU 38.A N ARG 35.A O no hydrogen 3.193 N/A ARG 39.A NH1 THR 133.A O no hydrogen 3.072 N/A ARG 39.A NH1 THR 154.A OG1 no hydrogen 3.036 N/A ARG 39.A NH2 THR 133.A O no hydrogen 3.244 N/A PHE 40.A N THR 155.A O no hydrogen 2.931 N/A MET 42.A N ASP 153.A O no hydrogen 3.124 N/A CYS 43.A SG ALA 41.A O no hydrogen 3.795 N/A SER 44.A OG SER 104.A OG no hydrogen 2.637 N/A THR 45.A N MET 42.A O no hydrogen 3.217 N/A THR 45.A OG1 MET 42.A O no hydrogen 2.542 N/A THR 45.A OG1 TYR 236.A OH no hydrogen 3.097 N/A SER 46.A N CYS 43.A O no hydrogen 3.129 N/A SER 46.A OG CYS 43.A O no hydrogen 2.822 N/A LYS 47.A N SER 44.A O no hydrogen 2.951 N/A LYS 47.A NZ SER 44.A OG no hydrogen 2.435 N/A LYS 47.A NZ ASN 106.A OD1 no hydrogen 3.304 N/A LYS 47.A NZ GLU 140.A OE2 no hydrogen 3.266 N/A VAL 48.A N THR 45.A O no hydrogen 3.266 N/A THR 50.A N SER 46.A O no hydrogen 3.318 N/A THR 50.A OG1 SER 46.A O no hydrogen 3.167 N/A ALA 51.A N LYS 47.A O no hydrogen 2.947 N/A ALA 52.A N VAL 48.A O no hydrogen 2.936 N/A ALA 53.A N MET 49.A O no hydrogen 3.086 N/A ALA 53.A N THR 50.A O no hydrogen 3.139 N/A VAL 54.A N THR 50.A O no hydrogen 3.425 N/A LEU 55.A N ALA 51.A O no hydrogen 3.104 N/A LYS 56.A N ALA 52.A O no hydrogen 2.913 N/A LYS 56.A NZ GLU 59.A OE1 no hydrogen 3.386 N/A LYS 56.A NZ GLU 59.A OE2 no hydrogen 3.499 N/A LYS 56.A NZ ALA 172.A O no hydrogen 2.841 N/A GLN 57.A N ALA 53.A O no hydrogen 3.236 N/A SER 58.A N VAL 54.A O no hydrogen 3.126 N/A SER 58.A OG LEU 55.A O no hydrogen 2.572 N/A GLU 59.A N LYS 56.A O no hydrogen 3.020 N/A THR 60.A N GLN 57.A O no hydrogen 2.976 N/A HIS 61.A N GLN 57.A O no hydrogen 3.001 N/A HIS 61.A ND1 GLN 57.A O no hydrogen 3.154 N/A ILE 64.A N HIS 61.A O no hydrogen 3.311 N/A GLN 66.A N GLY 63.A O no hydrogen 2.942 N/A GLN 67.A N ILE 64.A O no hydrogen 2.886 N/A MET 69.A N MET 91.A O no hydrogen 3.108 N/A ILE 71.A N ASN 89.A O no hydrogen 2.736 N/A LYS 72.A N ASP 75.A OD2 no hydrogen 2.711 N/A ASP 75.A N LYS 72.A O no hydrogen 2.640 N/A THR 77.A N ASN 80.A OD1 no hydrogen 2.806 N/A THR 77.A OG1 ASN 78.A OD1 no hydrogen 3.177 N/A ASN 78.A N THR 77.A OG1 no hydrogen 2.622 N/A ASN 80.A ND2 THR 77.A O no hydrogen 3.490 N/A VAL 82.A N ASP 105.A OD2 no hydrogen 3.054 N/A THR 83.A N ASP 105.A OD2 no hydrogen 3.023 N/A THR 83.A OG1 ASP 105.A OD1 no hydrogen 3.167 N/A THR 83.A OG1 ASP 105.A OD2 no hydrogen 2.997 N/A GLU 84.A N ASN 80.A O no hydrogen 3.337 N/A LYS 85.A N VAL 82.A O no hydrogen 2.923 N/A TYR 86.A N THR 83.A O no hydrogen 3.047 N/A GLY 88.A N ILE 71.A O no hydrogen 2.725 N/A ASN 89.A N TYR 86.A O no hydrogen 2.637 N/A MET 91.A N MET 69.A O no hydrogen 3.042 N/A THR 92.A N GLU 95.A OE1 no hydrogen 2.926 N/A LEU 93.A N GLN 67.A O no hydrogen 2.958 N/A ALA 94.A N LEU 65.A O no hydrogen 3.046 N/A GLU 95.A N THR 92.A OG1 no hydrogen 3.084 N/A LEU 96.A N THR 92.A O no hydrogen 2.959 N/A SER 97.A N LEU 93.A O no hydrogen 2.953 N/A SER 97.A OG LEU 93.A O no hydrogen 2.736 N/A ALA 98.A N ALA 94.A O no hydrogen 2.973 N/A ALA 99.A N GLU 95.A O no hydrogen 2.769 N/A THR 100.A N LEU 96.A O no hydrogen 2.948 N/A THR 100.A OG1 ASP 105.A O no hydrogen 3.260 N/A LEU 101.A N SER 97.A O no hydrogen 3.114 N/A GLN 102.A N ALA 98.A O no hydrogen 3.033 N/A GLN 102.A NE2 TRP 184.A O no hydrogen 3.154 N/A ASP 105.A N ALA 99.A O no hydrogen 3.119 N/A ASN 106.A N TRP 79.A O no hydrogen 2.985 N/A ASN 106.A ND2 ASN 78.A OD1 no hydrogen 2.660 N/A THR 107.A OG1 ASP 75.A O no hydrogen 3.391 N/A THR 107.A OG1 ASN 80.A OD1 no hydrogen 2.937 N/A ALA 108.A N ASP 105.A OD1 no hydrogen 2.976 N/A ASN 110.A N ASN 106.A O no hydrogen 3.233 N/A ASN 110.A ND2 GLU 140.A O no hydrogen 2.898 N/A LYS 111.A N THR 107.A O no hydrogen 3.116 N/A LYS 111.A NZ THR 70.A O no hydrogen 2.845 N/A LYS 111.A NZ ASP 75.A OD2 no hydrogen 3.357 N/A LEU 112.A N ALA 108.A O no hydrogen 3.145 N/A LEU 113.A N MET 109.A O no hydrogen 2.966 N/A ALA 114.A N ASN 110.A O no hydrogen 3.048 N/A HIS 115.A N LYS 111.A O no hydrogen 3.055 N/A HIS 115.A NE2 GLN 57.A OE1 no hydrogen 2.673 N/A LEU 116.A N LEU 112.A O no hydrogen 2.987 N/A GLY 117.A N LEU 113.A O no hydrogen 2.981 N/A GLY 117.A N ALA 114.A O no hydrogen 3.259 N/A GLY 118.A N LEU 113.A O no hydrogen 2.771 N/A ASN 121.A N GLY 118.A O no hydrogen 3.116 N/A ASN 121.A ND2 GLY 118.A O no hydrogen 3.325 N/A THR 123.A N PRO 119.A O no hydrogen 3.087 N/A THR 123.A OG1 PRO 119.A O no hydrogen 3.335 N/A THR 123.A OG1 LEU 136.A O no hydrogen 3.158 N/A ALA 124.A N GLY 120.A O no hydrogen 2.980 N/A PHE 125.A N ASN 121.A O no hydrogen 2.936 N/A ALA 126.A N VAL 122.A O no hydrogen 2.925 N/A ARG 127.A N THR 123.A O no hydrogen 3.059 N/A ARG 127.A NE ASP 131.A O no hydrogen 2.950 N/A SER 128.A N ALA 124.A O no hydrogen 2.856 N/A SER 128.A OG PHE 125.A O no hydrogen 2.619 N/A ILE 129.A N PHE 125.A O no hydrogen 3.245 N/A ILE 129.A N ALA 126.A O no hydrogen 3.073 N/A GLY 130.A N ARG 127.A O no hydrogen 3.091 N/A ASP 131.A N ALA 126.A O no hydrogen 3.102 N/A THR 133.A N ASP 131.A OD1 no hydrogen 2.784 N/A PHE 134.A N ASP 131.A OD1 no hydrogen 2.822 N/A ARG 135.A NE ASP 137.A OD1 no hydrogen 3.149 N/A ARG 135.A NH2 ASP 137.A OD1 no hydrogen 3.405 N/A ARG 135.A NH2 ASP 137.A OD2 no hydrogen 2.694 N/A LEU 136.A N THR 123.A OG1 no hydrogen 2.895 N/A ASP 137.A N ASP 153.A OD1 no hydrogen 2.624 N/A ARG 138.A N ASP 153.A OD1 no hydrogen 3.006 N/A ARG 138.A NE ASP 153.A OD2 no hydrogen 2.976 N/A ARG 138.A NH1 THR 145.A OG1 no hydrogen 2.892 N/A ARG 138.A NH2 THR 145.A OG1 no hydrogen 3.325 N/A ARG 138.A NH2 ASP 153.A OD2 no hydrogen 2.867 N/A LYS 139.A NZ GLU 142.A OE1 no hydrogen 3.522 N/A GLU 140.A N ASN 110.A OD1 no hydrogen 2.683 N/A LEU 143.A N LYS 139.A O no hydrogen 3.051 N/A ASN 144.A N PRO 141.A O no hydrogen 3.006 N/A THR 145.A N GLU 142.A O no hydrogen 3.144 N/A THR 145.A OG1 GLU 142.A O no hydrogen 3.455 N/A ASP 150.A N ILE 147.A O no hydrogen 2.881 N/A ARG 152.A N ASP 150.A OD1 no hydrogen 2.839 N/A ARG 152.A NE ASP 150.A OD1 no hydrogen 3.397 N/A ARG 152.A NE ASP 150.A OD2 no hydrogen 2.861 N/A ARG 152.A NH2 ASP 150.A OD2 no hydrogen 2.781 N/A ASP 153.A N ASP 137.A OD1 no hydrogen 2.856 N/A THR 154.A OG1 GLU 151.A O no hydrogen 2.767 N/A THR 155.A N PHE 40.A O no hydrogen 3.146 N/A SER 156.A OG ALA 36.A O no hydrogen 3.491 N/A LEU 158.A N ALA 36.A O no hydrogen 3.058 N/A ALA 159.A N SER 156.A OG no hydrogen 3.296 N/A MET 160.A N SER 156.A O no hydrogen 3.024 N/A ALA 161.A N PRO 157.A O no hydrogen 2.964 N/A LYS 162.A N LEU 158.A O no hydrogen 3.240 N/A SER 163.A N ALA 159.A O no hydrogen 3.163 N/A SER 163.A OG ASP 131.A OD2 no hydrogen 2.677 N/A SER 163.A OG ALA 159.A O no hydrogen 3.156 N/A LEU 164.A N MET 160.A O no hydrogen 3.064 N/A ARG 165.A N ALA 161.A O no hydrogen 2.999 N/A LYS 166.A N LYS 162.A O no hydrogen 2.888 N/A LYS 166.A NZ ILE 129.A O no hydrogen 3.146 N/A LEU 167.A N SER 163.A O no hydrogen 3.026 N/A THR 168.A N LEU 164.A O no hydrogen 2.954 N/A THR 168.A OG1 LEU 164.A O no hydrogen 2.581 N/A LEU 169.A N ARG 165.A O no hydrogen 2.691 N/A GLY 170.A N ARG 165.A O no hydrogen 2.912 N/A ALA 172.A N LYS 166.A O no hydrogen 3.249 N/A ALA 174.A N GLU 59.A OE2 no hydrogen 2.949 N/A GLN 177.A NE2 SER 58.A OG no hydrogen 2.965 N/A ARG 178.A N ALA 174.A O no hydrogen 2.806 N/A ALA 179.A N GLY 175.A O no hydrogen 3.020 N/A GLN 180.A N PRO 176.A O no hydrogen 3.035 N/A LEU 181.A N GLN 177.A O no hydrogen 2.965 N/A VAL 182.A N ARG 178.A O no hydrogen 3.038 N/A ASP 183.A N ALA 179.A O no hydrogen 2.953 N/A TRP 184.A N GLN 180.A O no hydrogen 3.026 N/A LEU 185.A N LEU 181.A O no hydrogen 3.044 N/A LYS 186.A N VAL 182.A O no hydrogen 3.072 N/A GLY 187.A N ASP 183.A O no hydrogen 3.175 N/A GLY 187.A N TRP 184.A O no hydrogen 3.072 N/A ASN 188.A N LEU 185.A O no hydrogen 3.347 N/A ASN 188.A ND2 THR 190.A OG1 no hydrogen 3.186 N/A ASN 188.A ND2 ASP 207.A OD1 no hydrogen 3.146 N/A ASN 188.A ND2 ASP 207.A OD2 no hydrogen 3.287 N/A THR 189.A N GLN 102.A O no hydrogen 3.053 N/A THR 189.A OG1 GLN 102.A O no hydrogen 2.886 N/A THR 190.A N ASN 188.A OD1 no hydrogen 3.175 N/A THR 190.A OG1 ASN 188.A OD1 no hydrogen 3.054 N/A THR 190.A OG1 THR 209.A OG1 no hydrogen 2.507 N/A SER 194.A N GLY 191.A O no hydrogen 3.145 N/A ILE 195.A N ASP 219.A OD2 no hydrogen 3.208 N/A ARG 196.A NE ASP 207.A OD1 no hydrogen 2.957 N/A ARG 196.A NH2 VAL 205.A O no hydrogen 3.183 N/A ARG 196.A NH2 ASP 207.A OD1 no hydrogen 3.140 N/A ALA 197.A N SER 194.A O no hydrogen 2.757 N/A GLY 198.A N ILE 195.A O no hydrogen 2.808 N/A LEU 199.A N ARG 196.A O no hydrogen 2.977 N/A HIS 202.A NE2 GLU 226.A OE2 no hydrogen 2.654 N/A TRP 203.A N PRO 200.A O no hydrogen 3.026 N/A VAL 204.A N TRP 224.A O no hydrogen 3.311 N/A GLY 206.A N VAL 222.A O no hydrogen 3.264 N/A ASP 207.A N LEU 185.A O no hydrogen 2.987 N/A LYS 208.A N ILE 220.A O no hydrogen 3.121 N/A LYS 208.A NZ SER 104.A OG no hydrogen 3.131 N/A LYS 208.A NZ THR 209.A O no hydrogen 2.936 N/A THR 209.A OG1 THR 190.A OG1 no hydrogen 2.507 N/A GLY 210.A N ASN 218.A O no hydrogen 2.922 N/A GLY 212.A N THR 216.A O no hydrogen 3.066 N/A ASP 213.A N ASN 144.A O no hydrogen 3.151 N/A TYR 214.A N GLN 242.A O no hydrogen 2.834 N/A THR 216.A N ASP 213.A O no hydrogen 3.103 N/A THR 216.A OG1 ASP 213.A O no hydrogen 2.959 N/A THR 216.A OG1 THR 238.A OG1 no hydrogen 2.782 N/A THR 217.A N PHE 237.A O no hydrogen 2.665 N/A THR 217.A OG1 GLY 215.A O no hydrogen 2.706 N/A ASN 218.A N GLY 210.A O no hydrogen 2.909 N/A ASN 218.A ND2 ALA 41.A O no hydrogen 2.967 N/A ASN 218.A ND2 MET 42.A O no hydrogen 3.308 N/A ASP 219.A N THR 235.A O no hydrogen 3.282 N/A ILE 220.A N LYS 208.A O no hydrogen 3.157 N/A ALA 221.A N LEU 233.A O no hydrogen 2.862 N/A VAL 222.A N GLY 206.A O no hydrogen 3.082 N/A ILE 223.A N LEU 231.A O no hydrogen 2.745 N/A TRP 224.A N VAL 204.A O no hydrogen 2.981 N/A ARG 228.A N PRO 225.A O no hydrogen 2.988 N/A ARG 228.A NE LYS 262.A O no hydrogen 3.019 N/A ARG 228.A NH1 GLU 226.A OE1 no hydrogen 2.700 N/A ARG 228.A NH2 LYS 262.A O no hydrogen 3.064 N/A ARG 228.A NH2 LYS 262.A OXT no hydrogen 2.659 N/A LEU 231.A N ILE 223.A O no hydrogen 2.829 N/A VAL 232.A N ILE 24.A O no hydrogen 2.946 N/A LEU 233.A N ALA 221.A O no hydrogen 2.812 N/A VAL 234.A N ALA 22.A O no hydrogen 2.994 N/A THR 235.A N ASP 219.A O no hydrogen 3.152 N/A THR 235.A OG1 ASP 219.A O no hydrogen 3.407 N/A TYR 236.A N GLY 20.A O no hydrogen 2.626 N/A TYR 236.A OH THR 45.A OG1 no hydrogen 3.097 N/A PHE 237.A N ASN 218.A OD1 no hydrogen 3.065 N/A THR 238.A N ARG 18.A O no hydrogen 3.169 N/A THR 238.A OG1 THR 216.A OG1 no hydrogen 2.782 N/A GLN 239.A N TYR 214.A O no hydrogen 2.900 N/A GLN 239.A NE2 GLY 215.A O no hydrogen 3.324 N/A GLN 239.A NE2 LYS 245.A O no hydrogen 2.721 N/A ALA 244.A N GLN 241.A O no hydrogen 2.933 N/A TRP 246.A NE1 GLY 212.A O no hydrogen 3.151 N/A ARG 247.A N THR 217.A OG1 no hydrogen 3.038 N/A ARG 247.A NE ASP 249.A OD1 no hydrogen 2.965 N/A ARG 247.A NH2 ASP 249.A OD2 no hydrogen 2.979 N/A VAL 250.A N ARG 247.A O no hydrogen 2.848 N/A LEU 251.A N LYS 248.A O no hydrogen 3.215 N/A ALA 252.A N LYS 248.A O no hydrogen 3.269 N/A ALA 253.A N ASP 249.A O no hydrogen 3.060 N/A ALA 254.A N VAL 250.A O no hydrogen 3.167 N/A ALA 255.A N LEU 251.A O no hydrogen 2.904 N/A LYS 256.A N ALA 252.A O no hydrogen 3.147 N/A ILE 257.A N ALA 253.A O no hydrogen 3.106 N/A VAL 258.A N ALA 254.A O no hydrogen 3.265 N/A THR 259.A N ALA 255.A O no hydrogen 3.012 N/A THR 259.A OG1 ALA 255.A O no hydrogen 2.860 N/A LYS 262.A N THR 259.A O no hydrogen 3.011 N/A